ID: 97252
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 97253
SMILES:C(C)(C1CC2C(C)(Oc3c(c(O)cc(CCCCC)c3)C2)CC1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.989
InChIKey:FMEAUTFJQZCISA-UHFFFAOYSA-N
ID: 97254
SMILES:C1(CCC=C(C)C)(C)Oc2c(c(OC(C)=O)cc(CCCCC)c2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.271
InChIKey:ULUMBYIEFPOKMQ-UHFFFAOYSA-N
ID: 97255
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 97256
SMILES:CC1(C(=O)O)C2C(c3c(cc(CCCCC)cc3O)O1)C(O)C(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -13.537
InChIKey:JOUPPYMUTSRESW-UHFFFAOYSA-N
ID: 97257
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(OCC)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.633
InChIKey:MEOGMAFVBCNLTK-UHFFFAOYSA-N
ID: 97258
SMILES:Oc1c(C(C)C)ccc(C)c1-c1c2c(c(C)cc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 406.566
CB1 binding score: -15.888
InChIKey:SCGWFDJPGFWSPA-UHFFFAOYSA-N
ID: 97259
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2C=C(C)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 97260
SMILES:OCC(C1CC2C(C)(Oc3c(c(OC)cc(CCCCC)c3)C2)CC1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.591
InChIKey:FQBPQDUGKUMIOS-UHFFFAOYSA-N
ID: 97261
SMILES:C(=C(C)C)CCC(C)=CC1c2c(cc(CCCCC)cc2O)C(OC)C(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.342
InChIKey:DXNIMMXTFJFFPY-UHFFFAOYSA-N
ID: 97262
SMILES:C(C)CCCc1c(C(O)=O)c(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.507
InChIKey:YKKHSYLGQXKVMO-UHFFFAOYSA-N
ID: 97263
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(O2)C(C)(C)OCC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -16.751
InChIKey:XXLZQNAVDAYGIU-UHFFFAOYSA-N
ID: 97264
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 97265
SMILES:c12c(c3c(O)cc(CCCCC)cc3o1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -4.049
InChIKey:KQOJOVXYPDOAPR-UHFFFAOYSA-N
ID: 97266
SMILES:O=C(C)Oc1c2c(c(O)cc1CCCCC)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.321
InChIKey:VEZVRMSYECJVQE-UHFFFAOYSA-N
ID: 97267
SMILES:C(=C)(C)C1CCC(=C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.279
InChIKey:KLYPAQJXUITNGB-UHFFFAOYSA-N
ID: 97268
SMILES:C1C2(C)C(C(C)(C)CC1)C(O)C1c3c(O)cc(CCCCC)cc3OC1(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -13.957
InChIKey:DCPGCJYVAWRFAQ-UHFFFAOYSA-N
ID: 97269
SMILES:CC1(C(Cc2c(O)c(C)cc(OC)c2)(C)O)OOC(C=C(CCC=C(C)C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -16.502
InChIKey:KTDFCZAUVJGOKH-UHFFFAOYSA-N
ID: 97270
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N
ID: 97271
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1OC(CCC(C(=C)C)OC(=O)C(C)=C)(C2)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -15.379
InChIKey:BFDHLYBXLJVHLE-UHFFFAOYSA-N
ID: 97272
SMILES:O(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C(O)C(OC(C)=O)(C)CC1)c1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.617
CB1 binding score: -14.496
InChIKey:FTEMQRNGBFVTEE-UHFFFAOYSA-N